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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H34N10O20P4
Molecular Weight 894.4671
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MRNA CAP M7G+M3'-5'-PPP-5'-AM2'-3'-P-

SMILES

C[n+]1cn(c2c1c(nc(=N)[nH]2)O)[C@@]3([H])[C@@]([H])([C@@]([H])([C@@]([H])(COP(=O)(O)OP(=O)([O-])OP(=O)(O)OC[C@]4([H])[C@]([H])([C@]([H])([C@]([H])(n5cnc6c(N)ncnc65)O4)OC)OP(=O)(O)O)O3)OC)O

InChI

InChIKey=OSGNANJQOHIBRB-LAMCKDNKSA-N
InChI=1S/C23H34N10O20P4/c1-31-8-33(19-12(31)20(35)30-23(25)29-19)21-13(34)14(45-2)9(49-21)4-47-55(39,40)52-57(43,44)53-56(41,42)48-5-10-15(51-54(36,37)38)16(46-3)22(50-10)32-7-28-11-17(24)26-6-27-18(11)32/h6-10,13-16,21-22,34H,4-5H2,1-3H3,(H9-,24,25,26,27,29,30,35,36,37,38,39,40,41,42,43,44)/t9-,10-,13-,14-,15-,16-,21-,22-/m1/s1

HIDE SMILES / InChI

Molecular Formula C23H34N10O20P4
Molecular Weight 894.4671
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Jun 25 20:47:09 UTC 2021
Edited
by admin
on Fri Jun 25 20:47:09 UTC 2021
Record UNII
VNP8CZY34V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MRNA CAP M7G+M3'-5'-PPP-5'-AM2'-3'-P-
Common Name English
Code System Code Type Description
PUBCHEM
155884733
Created by admin on Fri Jun 25 20:47:09 UTC 2021 , Edited by admin on Fri Jun 25 20:47:09 UTC 2021
PRIMARY
FDA UNII
VNP8CZY34V
Created by admin on Fri Jun 25 20:47:09 UTC 2021 , Edited by admin on Fri Jun 25 20:47:09 UTC 2021
PRIMARY